General Information of the Compound
| Compound ID |
CP0414293
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| Compound Name |
3-[(7-methoxyspiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)methyl]benzonitrile
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| Structure |
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| Formula |
C24H24N4O
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| Molecular Weight |
384.483
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| Canonical SMILES |
COc1ccc-2c(NC3(CCN(Cc4cccc(c4)C#N)CC3)c3cccn-23)c1
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| InChI |
InChI=1S/C24H24N4O/c1-29-20-7-8-22-21(15-20)26-24(23-6-3-11-28(22)23)9-12-27(13-10-24)17-19-5-2-4-18(14-19)16-25/h2-8,11,14-15,26H,9-10,12-13,17H2,1H3
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| InChIKey |
JVDZSUFDTNLDRV-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha